![N-[3-methyl-1-(3-methylanilino)-1-oxobut-2-en-2-yl]benzamide structure](/static/products/4136/413612-43-8.webp)
N-[3-methyl-1-(3-methylanilino)-1-oxobut-2-en-2-yl]benzamide
TL;DR: N-[3-methyl-1-(3-methylanilino)-1-oxobut-2-en-2-yl]benzamide (CAS 413612-43-8) is a chemical compound with molecular formula C19H20N2O2 and molecular weight 308.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[3-methyl-1-(3-methylanilino)-1-oxobut-2-en-2-yl]benzamide
Also Known As: BIM-0030876.P001, N-[3-methyl-1-(3-methylanilino)-1-oxobut-2-en-2-yl]benzamide, BENZAMIDE, N-[2-METHYL-1-[[(3-METHYLPHENYL)AMINO]CARBONYL]-1-PROPENYL]-, Benzamide,N-[2-methyl-1-[[ amino]carbonyl]-1-propenyl]-, N-(2-methyl-1-{[(3-methylphenyl)amino]carbonyl}-1-propen-1-yl)benzamide
| Molecular Formula | C19H20N2O2 |
|---|---|
| Molecular Weight | 308.15 g/mol |
| LogP | 3.65742 |
| Topological Polar Surface Area | 58.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 308.15247 |
| Heavy Atoms | 23 |
| Complexity | 744.97473 |
Chemical Identifiers
| CAS Number | 413612-43-8 |
|---|---|
| SMILES | CC1=CC(=CC=C1)NC(=O)C(=C(C)C)NC(=O)C2=CC=CC=C2 |
Product Overview
N-[3-methyl-1-(3-methylanilino)-1-oxobut-2-en-2-yl]benzamide (CAS 413612-43-8), with molecular formula C19H20N2O2 and molecular weight 308.15 g/mol. IUPAC: N-[3-methyl-1-(3-methylanilino)-1-oxobut-2-en-2-yl]benzamide.
Chemical Property Profile of N-[3-methyl-1-(3-methylanilino)-1-oxobut-2-en-2-yl]benzamide
Property Insights of N-[3-methyl-1-(3-methylanilino)-1-oxobut-2-en-2-yl]benzamide
The XLogP value of 3.65742 indicates that N-[3-methyl-1-(3-methylanilino)-1-oxobut-2-en-2-yl]benzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 58.2 Ų, N-[3-methyl-1-(3-methylanilino)-1-oxobut-2-en-2-yl]benzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-[3-methyl-1-(3-methylanilino)-1-oxobut-2-en-2-yl]benzamide has 2 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N-[3-methyl-1-(3-methylanilino)-1-oxobut-2-en-2-yl]benzamide?
The CAS number of N-[3-methyl-1-(3-methylanilino)-1-oxobut-2-en-2-yl]benzamide is 413612-43-8.
What is the molecular formula of N-[3-methyl-1-(3-methylanilino)-1-oxobut-2-en-2-yl]benzamide?
The molecular formula of N-[3-methyl-1-(3-methylanilino)-1-oxobut-2-en-2-yl]benzamide is C19H20N2O2.
What is the molecular weight of N-[3-methyl-1-(3-methylanilino)-1-oxobut-2-en-2-yl]benzamide?
The molecular weight of N-[3-methyl-1-(3-methylanilino)-1-oxobut-2-en-2-yl]benzamide is 308.15 g/mol.
Where can I buy N-[3-methyl-1-(3-methylanilino)-1-oxobut-2-en-2-yl]benzamide?
You can request a quote for N-[3-methyl-1-(3-methylanilino)-1-oxobut-2-en-2-yl]benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[3-methyl-1-(3-methylanilino)-1-oxobut-2-en-2-yl]benzamide?
Yes, KEHONG BIO provides custom synthesis services for N-[3-methyl-1-(3-methylanilino)-1-oxobut-2-en-2-yl]benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.